1-(2-Chloro-4-fluorophenyl)cyclopentanecarbonitrile - CAS 214262-92-7

Name: 1-(2-Chloro-4-fluorophenyl)cyclopentanecarbonitrile
Brand: BOC Sciences
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Catalog:	BB016837
Product Name:	1-(2-Chloro-4-fluorophenyl)cyclopentanecarbonitrile
CAS:	214262-92-7
Synonyms:	1-(2-chloro-4-fluorophenyl)-1-cyclopentanecarbonitrile; 1-(2-chloro-4-fluorophenyl)cyclopentane-1-carbonitrile

Technical Data

IUPAC Name:	1-(2-chloro-4-fluorophenyl)cyclopentane-1-carbonitrile
Description:	1-(2-Chloro-4-fluorophenyl)cyclopentanecarbonitrile (CAS# 214262-92-7) is a useful research chemical.
Molecular Weight:	223.67
Molecular Formula:	C12H11ClFN
Canonical SMILES:	C1CCC(C1)(C#N)C2=C(C=C(C=C2)F)Cl
InChI:	InChI=1S/C12H11ClFN/c13-11-7-9(14)3-4-10(11)12(8-15)5-1-2-6-12/h3-4,7H,1-2,5-6H2
InChI Key:	BGCPHKLPEOZLGI-UHFFFAOYSA-N
Boiling Point:	332.3 °C at 760 mmHg
Density:	1.24 g/cm³
MDL:	MFCD00800618
LogP:	3.81448

Publication Number	Title	Priority Date
EP-2094677-A1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
EP-2094677-B1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
US-2010144709-A1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
US-7960556-B2	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
WO-2008061781-A1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122

Complexity:	277
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	223.0564052
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	223.0564052
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.7